Project name: kanti [mutate: LA37A, LA175A] [mutate: VA31A, FA59A, FA103A, VA156A]

Status: done

submitted: 2018-08-04 16:11:55, status changed: 2018-08-04 16:18:34
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Chain sequence(s) A: QDFYDFKAVNIRGKAVSLEKYRGSVSLVVNVASECGFTDQHYRALQQLQRDLGPHHFNVLAFPCNQFGQQEPDSNKEIESFARRTYSVSFPMFSKIAVTGTGAHPAFKYLAQTSGKEPTWNFWKYLVAPDGKVVGAWDPTVSVEEVRPQITAAVR
Distance of aggregation 5 Å
Dynamic mode No
Mutated residues VA31A, FA59A, FA103A, VA156A
Energy difference between WT (input) and mutated protein (by FoldX) 4.95589 kcal/mol

CAUTION: Your mutation/s can destabilize the protein structure

Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive.

Show buried residues

Minimal score value
-2.168
Maximal score value
0.5056
Average score
-0.4313
Total score value
-66.8521

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan3D score mutation
residue index residue name chain Aggrescan3D score
mutation
23 Q A -1.2400
24 D A -0.4469
25 F A 0.0000
26 Y A 0.0000
27 D A -0.7743
28 F A -0.2594
29 K A -1.6764
30 A A 0.0000
31 A A -0.0062 mutated: VA31A
32 N A -0.2362
33 I A 0.0000
34 R A -1.9287
35 G A -1.1184
36 K A -1.7763
37 A A -0.1967
38 V A 0.2762
39 S A -0.2688
40 L A 0.0000
41 E A -1.9766
42 K A -2.0047
43 Y A 0.0000
44 R A -0.6722
45 G A -0.2986
46 S A 0.0000
47 V A 0.0000
48 S A 0.0000
49 L A 0.0000
50 V A 0.0000
51 V A 0.0000
52 N A 0.0000
53 V A 0.0000
54 A A 0.0000
55 S A -0.4082
56 E A -1.8470
57 C A -0.3503
58 G A -0.4514
59 A A -0.0731 mutated: FA59A
60 T A 0.0000
61 D A -1.2664
62 Q A -1.3905
63 H A 0.0000
64 Y A 0.0000
65 R A -1.8426
66 A A -0.3307
67 L A 0.0000
68 Q A 0.0000
69 Q A -1.3916
70 L A 0.0000
71 Q A -0.4719
72 R A -2.1680
73 D A -1.3140
74 L A 0.0000
75 G A -0.1747
76 P A -0.3858
77 H A -0.8295
78 H A -1.0994
79 F A 0.0000
80 N A -0.2269
81 V A 0.0000
82 L A 0.0000
83 A A 0.0000
84 F A 0.0000
85 P A 0.0000
86 C A 0.0000
87 N A -0.5015
88 Q A -0.6133
89 F A 0.0019
90 G A -0.6476
91 Q A -1.3560
92 Q A -0.6580
93 E A 0.0000
94 P A -0.4880
95 D A -1.5791
96 S A -0.5060
97 N A -0.9829
98 K A -2.1148
99 E A -1.9330
100 I A 0.0000
101 E A 0.0000
102 S A -0.0391
103 A A 0.0126 mutated: FA103A
104 A A 0.0000
105 R A -0.8945
106 R A -1.9539
107 T A -0.3821
108 Y A 0.1182
109 S A -0.2490
110 V A 0.0000
111 S A -0.2129
112 F A 0.0000
113 P A -0.0450
114 M A 0.0000
115 F A 0.0000
116 S A -0.1457
117 K A -0.5058
118 I A 0.2131
119 A A 0.0695
120 V A 0.0000
121 T A -0.0962
122 G A -0.4813
123 T A -0.2430
124 G A -0.4794
125 A A 0.0000
126 H A -0.1560
127 P A -0.3413
128 A A 0.0000
129 F A 0.0000
130 K A -1.0879
131 Y A -0.0596
132 L A 0.0000
133 A A -0.4057
134 Q A -1.2014
135 T A -0.2489
136 S A -0.1244
137 G A -0.7261
138 K A -1.7771
139 E A -1.8496
140 P A 0.0000
141 T A 0.0231
142 W A 0.5056
143 N A 0.0000
144 F A 0.0000
145 W A 0.0000
146 K A 0.0000
147 Y A 0.0000
148 L A 0.0000
149 V A 0.0000
150 A A 0.0030
151 P A -0.3946
152 D A -1.7980
153 G A 0.0000
154 K A -1.2535
155 V A -0.0020
156 A A 0.0874 mutated: VA156A
157 G A -0.0637
158 A A 0.0264
159 W A 0.0596
160 D A -0.5182
161 P A -0.1402
162 T A -0.0238
163 V A 0.2500
164 S A -0.0234
165 V A -0.1537
166 E A -2.1161
167 E A -2.1498
168 V A 0.0000
169 R A -0.9238
170 P A -0.4523
171 Q A -0.6955
172 I A 0.0000
173 T A -0.0314
174 A A 0.0578
175 A A 0.0761
176 V A -0.1037
177 R A -1.8004

 

Laboratory of Theory of Biopolymers 2015